M621-0441 Screening compound: 8-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}-1,4-dioxa-8-azaspiro[4.5]decane

M621-0441 Screening compound: 8-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}-1,4-dioxa-8-azaspiro[4.5]decane
M621-0441 Screening compound: 8-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound M621-0441
8-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}-1,4-dioxa-8-azaspiro[4.5]decane

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

M621-0441

Molecular Formula

C23H26N4O3 (C23 H26 N4 O3)

Compound Name

8-{3-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]benzoyl}-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-{3-[3-(propan-2-yl)-3H-imidazo[45-b]pyridin-2-yl]benzoyl}-14-dioxa-8-azaspiro[4.5]decane

SMILES

CC(C)n1c(-c2cccc(C(N(CC3)CCC33OCCO3)=O)c2)nc2c1nccc2

InChI

InChI=1S/C23H26N4O3/c1-16(2)27-20(25-19-7-4-10-24-21(19)27)17-5-3-6-18(15-17)22(28)26-11-8-23(9-12-26)29-13-14-30-23/h3-7,10,15-16H,8-9,11-14H2,1-2H3

InChI Key

JYPGNNPRQBHAFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27549315

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.488

Distribution Coefficient, logD

2.487

Water Solubility, LogSw

-2.60

Polar Surface Area

52.234

Acid Dissociation Constant (pKa)

17.07

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

M621-0441 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

GPCR Targeted Library (31838 compounds)

PI3K-Targeted Library (17255 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M621-0441 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M621-0441?
Check Price and Availability of M621-0441, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M621-0441 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M621-0441
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M621-0441
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of M621-0441 available by request